2,5,6,11,12-pentafluorotetracene

C18H7F5 — CID 139777268

IUPAC2,5,6,11,12-pentafluorotetracene
SMILESFc1ccc2c(F)c3c(F)c4ccccc4c(F)c3c(F)c2c1
InChIInChI=1S/C18H7F5/c19-8-5-6-11-12(7-8)18(23)14-13(17(11)22)15(20)9-3-1-2-4-10(9)16(14)21/h1-7H
InChIKeyLTFWKNHFQGDYDE-UHFFFAOYSA-N
MW318.24 g/mol
LogP5.84
Rot. Bonds

About 2,5,6,11,12-pentafluorotetracene

2,5,6,11,12-pentafluorotetracene (PubChem CID 139777268) has the molecular formula C18H7F5 and a molecular weight of 318.24 g/mol. Its IUPAC name is 2,5,6,11,12-pentafluorotetracene.

Molecular Properties

Compound Name2,5,6,11,12-pentafluorotetracene
PubChem CID139777268
Molecular FormulaC18H7F5
Molecular Weight318.24 g/mol
Exact Mass318.05
IUPAC Name2,5,6,11,12-pentafluorotetracene
SMILESFc1ccc2c(F)c3c(F)c4ccccc4c(F)c3c(F)c2c1
InChIInChI=1S/C18H7F5/c19-8-5-6-11-12(7-8)18(23)14-13(17(11)22)15(20)9-3-1-2-4-10(9)16(14)21/h1-7H
InChIKeyLTFWKNHFQGDYDE-UHFFFAOYSA-N
XLogP5.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.24
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2,5,6,11,12-pentafluorotetracene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5,6,11,12-pentafluorotetracene?
The IUPAC name of 2,5,6,11,12-pentafluorotetracene (CID 139777268) is 2,5,6,11,12-pentafluorotetracene.
What is the SMILES notation for 2,5,6,11,12-pentafluorotetracene?
The canonical SMILES for 2,5,6,11,12-pentafluorotetracene is Fc1ccc2c(F)c3c(F)c4ccccc4c(F)c3c(F)c2c1.
What is the InChIKey of 2,5,6,11,12-pentafluorotetracene?
The InChIKey is LTFWKNHFQGDYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H7F5/c19-8-5-6-11-12(7-8)18(23)14-13(17(11)22)15(20)9-3-1-2-4-10(9)16(14)21/h1-7H.
What are the key properties of 2,5,6,11,12-pentafluorotetracene?
2,5,6,11,12-pentafluorotetracene has a molecular weight of 318.24 g/mol, XLogP of 5.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,6,11,12-pentafluorotetracene is sourced from PubChem (CID 139777268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).